2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum

C29H23N4O2Pt- — CID 176605947

About 2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum

2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum (PubChem CID 176605947) has the molecular formula C29H23N4O2Pt- and a molecular weight of 654.61 g/mol. Its IUPAC name is 2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum.

Molecular Properties

• Compound Name: 2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum
• PubChem CID: 176605947
• Molecular Formula: C29H23N4O2Pt-
• Molecular Weight: 654.61 g/mol
• Exact Mass: 654.15
• IUPAC Name: 2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum
• SMILES: Cc1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(N(C)C)ccn2)nc2c(O)cccc12.[Pt]
• InChI: InChI=1S/C29H23N4O2.Pt/c1-18-15-28(31-29-21(18)8-6-10-26(29)34)35-20-11-12-23-22-7-4-5-9-24(22)33(25(23)17-20)27-16-19(32(2)3)13-14-30-27;/h4-16,34H,1-3H3;/q-1
• InChIKey: PLEUVMZMZZDNHX-UHFFFAOYSA-N
• XLogP: 6.40
• TPSA: 63.41 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	654.61
LogP ≤ 5	6.40
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum?

The IUPAC name of 2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum (CID 176605947) is 2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum.

What is the SMILES notation for 2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum?

The canonical SMILES for 2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum is Cc1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(N(C)C)ccn2)nc2c(O)cccc12.[Pt].

What is the InChIKey of 2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum?

The InChIKey is PLEUVMZMZZDNHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H23N4O2.Pt/c1-18-15-28(31-29-21(18)8-6-10-26(29)34)35-20-11-12-23-22-7-4-5-9-24(22)33(25(23)17-20)27-16-19(32(2)3)13-14-30-27;/h4-16,34H,1-3H3;/q-1;.

What are the key properties of 2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum?

2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum has a molecular weight of 654.61 g/mol, XLogP of 6.40, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum is sourced from PubChem (CID 176605947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).